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1SCF INDO CIS TDIP comment1 comment2 C -0.67 0.00 0.0 C 0.67 0.00 0.0 H -1.23 -0.93 0.0 H -1.23 0.93 0.0 H 1.23 -0.93 0.0 H 1.23 0.93 0.0